#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bai n ALA 2 N 0.00 0.15 -2.11 -5.12 0.00 -1.26 -4.94 120.51 107.23 2bai n ALA 2 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2bai n ALA 2 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2bai n ALA 2 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2bai s THR 3 N 0.19 3.64 -0.14 0.00 2.01 -1.26 -4.87 115.64 115.22 2bai s THR 3 Ca 0.00 0.67 -0.26 0.00 0.31 0.00 0.00 61.69 62.42 2bai s THR 3 Cb 0.00 -3.79 -0.25 0.00 0.01 0.00 0.00 72.50 68.46 2bai s THR 3 CO 0.00 -0.46 0.67 0.74 -0.69 0.00 0.00 174.62 174.88 2bai h THR 4 N 6.54 1.54 0.00 -0.82 2.02 -1.98 -3.47 112.91 116.73 2bai h THR 4 Ca -0.32 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.51 2bai h THR 4 Cb 1.15 3.10 0.00 0.00 -1.74 0.00 0.00 68.15 70.66 2bai h THR 4 CO 1.03 0.57 0.00 0.23 0.37 0.00 0.00 175.52 177.73 2bai n MET 5 N -4.46 0.00 -3.00 6.66 2.00 -1.26 -4.61 117.12 112.44 2bai n MET 5 Ca -0.16 0.00 -0.20 0.00 0.00 0.00 0.00 57.70 57.34 2bai n MET 5 Cb 0.59 0.00 0.04 0.00 0.00 0.00 0.00 33.22 33.85 2bai n MET 5 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 2bai n GLU 6 N 0.00 -4.72 -0.08 0.03 2.13 -1.26 -4.89 120.64 111.85 2bai n GLU 6 Ca 0.00 0.79 -0.13 0.00 0.66 0.00 0.00 57.16 58.48 2bai n GLU 6 Cb 0.00 -5.43 -0.06 0.00 0.27 0.00 0.00 31.44 26.22 2bai n GLU 6 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2bai n GLN 7 N -3.75 0.36 -2.39 5.31 6.02 -1.26 -4.90 117.38 116.77 2bai n GLN 7 Ca -0.08 0.11 -0.02 0.00 -0.01 0.00 0.00 57.00 56.99 2bai n GLN 7 Cb 0.60 -1.21 0.09 0.00 1.02 0.00 0.00 30.24 30.74 2bai n GLN 7 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2bai n GLU 8 N -3.23 0.96 -3.47 -1.09 0.28 -1.26 -4.68 120.64 108.16 2bai n GLU 8 Ca -0.28 -0.95 -0.19 0.00 -0.16 0.00 0.00 57.16 55.58 2bai n GLU 8 Cb 0.76 0.26 -0.12 0.00 1.43 0.00 0.00 31.44 33.76 2bai n GLU 8 CO 0.00 0.00 0.00 0.96 -0.16 0.00 0.00 177.13 177.93 2bai s ILE 9 N 0.10 -0.33 0.04 3.84 -0.00 1.27 -3.07 121.20 123.05 2bai s ILE 9 Ca 0.08 -0.24 0.00 0.00 -0.00 0.00 0.00 60.65 60.49 2bai s ILE 9 Cb 0.32 -0.77 0.00 0.00 -0.00 0.00 0.00 42.46 42.01 2bai s ILE 9 CO -0.09 -0.29 0.03 0.00 -0.00 0.00 0.00 174.94 174.58 2bai h ALA 11 N 0.78 1.46 0.00 0.00 0.00 -1.99 -2.04 119.26 117.46 2bai h ALA 11 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2bai h ALA 11 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2bai h ALA 11 CO 0.05 -0.46 -0.42 0.72 0.00 0.00 0.00 179.25 179.14 2bai n HIS 12 N -2.72 0.32 0.00 0.00 8.25 -1.26 -5.03 115.22 114.79 2bai n HIS 12 Ca -0.01 0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2bai n HIS 12 Cb 0.50 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.17 2bai n HIS 12 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2bai n SER 13 N -3.64 0.00 -0.02 0.41 7.64 -0.77 -5.12 113.62 112.12 2bai n SER 13 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 2bai n SER 13 Cb 0.22 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 2bai n SER 13 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2bai n MET 14 N 0.00 0.00 -3.73 1.43 0.00 -1.17 -4.63 117.12 109.01 2bai n MET 14 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 57.70 57.45 2bai n MET 14 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 33.22 33.20 2bai n MET 14 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2bai s THR 15 N -1.10 5.21 0.45 2.03 -4.23 -1.22 0.39 115.64 117.17 2bai s THR 15 Ca 0.00 -0.59 0.28 0.00 -1.18 0.00 0.00 61.69 60.20 2bai s THR 15 Cb 0.00 -3.79 0.48 0.00 1.34 0.00 0.00 72.50 70.52 2bai s THR 15 CO 0.00 -0.29 1.72 -0.26 -0.54 0.00 0.00 174.62 175.25 2bai h PHE 16 N 1.54 0.44 0.00 3.99 0.04 -1.92 1.97 116.94 123.00 2bai h PHE 16 Ca -0.49 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.15 2bai h PHE 16 Cb 1.21 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 39.22 2bai h PHE 16 CO 0.51 -0.04 -0.68 0.93 -0.60 0.00 0.00 178.31 178.43 2bai h GLU 17 N 0.19 0.00 -0.01 1.51 4.39 -1.96 -2.86 114.58 115.84 2bai h GLU 17 Ca 0.68 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.38 2bai h GLU 17 Cb 2.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.79 2bai h GLU 17 CO -0.26 0.68 -0.18 0.39 -1.16 0.00 0.00 179.01 178.48 2bai n GLU 18 N -3.64 1.34 -0.29 2.33 1.02 0.60 -4.08 120.64 117.92 2bai n GLU 18 Ca -0.01 -0.90 0.04 0.00 -0.02 0.00 0.00 57.16 56.27 2bai n GLU 18 Cb 0.69 -1.48 0.18 0.00 -0.02 0.00 0.00 31.44 30.81 2bai n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bai n PRO 20 N -4.78 0.01 -0.04 0.00 -0.04 -1.26 -2.49 135.00 126.40 2bai n PRO 20 Ca 0.14 0.13 0.01 0.00 -0.04 0.00 0.00 63.50 63.75 2bai n PRO 20 Cb 0.31 -1.51 -0.16 0.00 -0.04 0.00 0.00 33.50 32.10 2bai n PRO 20 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2bai n LYS 21 N -1.53 0.67 -0.21 0.54 4.76 0.22 -2.89 118.16 119.72 2bai n LYS 21 Ca 0.05 -0.09 0.01 0.00 -2.87 0.00 0.00 58.31 55.41 2bai n LYS 21 Cb 0.26 -1.54 0.10 0.00 -1.84 0.00 0.00 35.03 32.01 2bai n LYS 21 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bai h SER 23 N 0.10 0.29 -0.47 0.00 0.87 -1.75 -2.77 113.55 109.83 2bai h SER 23 Ca 0.33 -0.81 -0.35 0.00 -1.23 0.00 0.00 61.79 59.73 2bai h SER 23 Cb 0.54 -0.10 -0.11 0.00 -0.44 0.00 0.00 62.40 62.29 2bai h SER 23 CO -0.56 1.72 0.21 0.00 -0.53 0.00 0.00 176.83 177.68 2bai n ALA 24 N -3.12 6.48 0.43 6.23 0.00 -1.00 -3.94 120.51 125.59 2bai n ALA 24 Ca -0.31 -2.47 0.09 0.00 0.00 0.00 0.00 53.44 50.75 2bai n ALA 24 Cb 0.92 -2.32 -0.12 0.00 0.00 0.00 0.00 19.45 17.93 2bai n ALA 24 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2bai n LEU 25 N 1.87 0.44 -0.33 0.00 0.00 0.19 -4.61 117.00 114.56 2bai n LEU 25 Ca 0.48 -0.26 -0.04 0.00 0.00 0.00 0.00 56.01 56.19 2bai n LEU 25 Cb 0.72 0.00 -0.02 0.00 0.00 0.00 0.00 43.42 44.12 2bai n LEU 25 CO 0.26 0.11 -0.04 0.00 0.00 0.00 0.00 177.39 177.72 2bai n GLN 26 N -1.78 -0.97 -0.49 1.96 6.02 -1.25 -4.84 117.38 116.03 2bai n GLN 26 Ca 0.00 0.51 0.08 0.00 -0.01 0.00 0.00 57.00 57.58 2bai n GLN 26 Cb 0.38 -4.38 0.26 0.00 1.02 0.00 0.00 30.24 27.52 2bai n GLN 26 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2bai n TYR 27 N -2.54 1.01 -2.40 1.08 4.02 -1.26 -4.93 117.16 112.13 2bai n TYR 27 Ca -0.04 -0.92 -0.04 0.00 -0.01 0.00 0.00 57.90 56.88 2bai n TYR 27 Cb 0.31 -0.34 -0.00 0.00 -0.02 0.00 0.00 39.34 39.29 2bai n TYR 27 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2bai n ARG 28 N -0.51 -2.63 -0.06 -0.72 5.12 -1.26 -4.78 116.66 111.81 2bai n ARG 28 Ca 0.23 0.21 -0.04 0.00 -1.93 0.00 0.00 57.85 56.32 2bai n ARG 28 Cb 0.92 -4.72 -0.03 0.00 -1.16 0.00 0.00 32.46 27.47 2bai n ARG 28 CO 0.00 0.00 0.00 -0.97 -1.93 0.00 0.00 177.63 174.73 2bai h ASN 29 N 0.00 0.00 -0.37 0.55 -1.24 -1.86 -3.36 115.58 109.29 2bai h ASN 29 Ca -0.10 -0.17 0.00 0.00 0.71 0.00 0.00 56.30 56.74 2bai h ASN 29 Cb 1.03 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.08 2bai h ASN 29 CO 0.12 0.67 0.00 0.61 -1.29 0.00 0.00 177.43 177.54 2bai n GLY 30 N 1.71 1.30 3.33 1.57 0.00 -1.04 -4.66 105.19 107.40 2bai n GLY 30 Ca -0.04 -0.62 -0.45 0.00 0.00 0.00 0.00 46.02 44.91 2bai n GLY 30 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2bai n PHE 31 N 1.08 5.07 1.00 1.61 -0.00 -1.26 -4.61 117.46 120.35 2bai n PHE 31 Ca 0.18 -3.77 0.12 0.00 -0.00 0.00 0.00 57.45 53.99 2bai n PHE 31 Cb 0.50 -1.75 0.10 0.00 -0.00 0.00 0.00 39.48 38.33 2bai n PHE 31 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.76 179.24